File name: Pandora55s1_QueensNY_20201120_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T173020.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c10p1-8 Local principal investigator: James Szykman Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora55_OF_v3d20190723.txt Instrument calibration file used: Pandora55s1_CF_v10d20200414.txt Level 1 file used: Pandora55s1_QueensNY_20201120_L1_smca1c10d20200414p1-8.txt Full location name: Queens College NYSDEC (USEPA AQS ID 36-081-0124) Short location name: QueensNY Country of location: USA Location latitude [deg]: 40.7361 Location longitude [deg]: -73.8215 Location altitude [m]: 25 Local noon date: 20201120 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 262 404 Nominal wavelengths inside fitting window [nm]: 305.1379 305.2779 305.4179 305.5579 305.6978 305.8378 305.9778 306.1177 306.2576 306.3976 306.5375 306.6774 306.8172 306.9571 307.0970 307.2369 307.3767 307.5165 307.6564 307.7962 307.9360 308.0758 308.2156 308.3553 308.4951 308.6349 308.7746 308.9143 309.0541 309.1938 309.3335 309.4732 309.6128 309.7525 309.8922 310.0318 310.1715 310.3111 310.4507 310.5903 310.7299 310.8695 311.0091 311.1486 311.2882 311.4277 311.5673 311.7068 311.8463 311.9858 312.1253 312.2648 312.4043 312.5437 312.6832 312.8226 312.9621 313.1015 313.2409 313.3803 313.5197 313.6591 313.7984 313.9378 314.0771 314.2165 314.3558 314.4951 314.6344 314.7737 314.9130 315.0523 315.1915 315.3308 315.4700 315.6092 315.7485 315.8877 316.0269 316.1661 316.3052 316.4444 316.5836 316.7227 316.8618 317.0010 317.1401 317.2792 317.4183 317.5574 317.6964 317.8355 317.9745 318.1136 318.2526 318.3916 318.5306 318.6696 318.8086 318.9476 319.0866 319.2255 319.3645 319.5034 319.6423 319.7812 319.9201 320.0590 320.1979 320.3368 320.4756 320.6145 320.7533 320.8922 321.0310 321.1698 321.3086 321.4474 321.5861 321.7249 321.8636 322.0024 322.1411 322.2798 322.4185 322.5572 322.6959 322.8346 322.9733 323.1119 323.2506 323.3892 323.5278 323.6665 323.8051 323.9436 324.0822 324.2208 324.3594 324.4979 324.6364 324.7750 324.9135 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20201120T124030.2Z 7629.528127 68 1 50.39 2 82.35 124.62 139.29 76.36 0.00 1 0.00 1 0 25 5.798e-01 2.161e-02 2.082e-01 3.928e-03 7.779554e-01 2.251780e-03 8.745128e-03 -6.000000e+00 3.476628e-01 223.18 -2.00 3.51 -2.00 321.58 0.00e+00 6.446450e-03 1.207354e-03 4.394482e-03 -6.000000e+00 1.734202e-02 279.89 -2.00 20.00 -2.00 321.10 0.00e+00 6.984 0.006 302.00 328.00 3 2.3910e-01 8.0151e-03 8.5732e-02 -6.0000e+00 8.5814e-01 3.6899e-01 1.1460e-02 5.8760e-02 -6.0000e+00 9.3965e-01 -4.9761e-01 1.1723e-02 2.3307e-02 -6.0000e+00 5.5270e-01 2.0245e-01 5.4226e-03 1.0829e-02 -6.0000e+00 2.3301e-01 1.9549e-04 -1.8233e-03 1.1566e-04 1.0368e-04 -6.0000e+00 1.8083e-02 1.6312e-02 -5.0542e-07 12 8 8 10 0 0 57.80 22.78 0.39 0.01631 0.00261 89 17 1 5 0 559.750 25.68 20.00 22.78 13.34 26.3 954.65 42054 900000 -262332 900000 900000 -177692 900000 -181763 900000 -257477 71266 -229802 -51407 900000 502 -89351 117474 900000 -8817 900000 -46415 28082 -61152 -4109 -46501 900000 -27282 -13514 -66809 -120 288349 -20675 -49789 11644 900000 -35532 -5058 96240 112231 -13502 13059 10756 24382 39932 20913 7466 29551 48405 29811 18218 4944 -5958 46989 32163 16017 26111 29917 25514 16322 9782 27030 6085 -3707 17906 1640 18584 -5574 11762 9831 3211 3361 13090 -3477 8251 2634 315 13265 1297 -298 -2820 8878 -2912 2290 -4182 386 -3149 -1203 -3039 -897 -1792 -1987 199 -703 -1 -2211 -1713 -1206 -1036 -2260 -1153 -1069 92 2189 866 -595 -2308 -371 -787 1214 -1672 -2182 155 -973 56 7 1267 1462 252 -435 -1816 -291 1342 1886 -15 1896 580 2292 479 135 114 1538 969 811 524 -120 -23 523 3 -2200 197 -554 140 -835 161 900000 -7759 900000 900000 -2083 900000 -2606 900000 -8612 272 -8037 -423 900000 4 -2006 449 900000 -119 900000 -917 272 -1467 -61 -1081 900000 -536 -233 -2021 -2 1102 -678 -2392 322 900000 -1538 -184 1574 1875 -852 710 633 1321 1918 1229 510 1709 2476 1943 1443 495 -734 3859 3270 1989 3065 3422 3001 2037 1298 3197 976 -737 3240 363 3545 -1347 2569 2436 945 1066 3895 -1179 2363 728 82 2952 341 -90 -1031 3374 -1392 1138 -2343 219 -1943 -763 -2001 -575 -1122 -1186 111 -394 0 -1486 -1318 -1058 -1018 -2410 -1229 -1085 85 1862 742 -538 -2243 -373 -850 1404 -2200 -3144 232 -1499 84 10 1797 2084 375 -679 -2929 -461 2042 2770 -22 2655 803 3077 680 211 197 2872 1929 1693 1151 -277 -54 1278 6 -5520 474 -1287 307 -1803 SS 20201120T125205.8Z 7629.536178 71 1 49.57 2 80.57 126.70 137.23 78.66 0.00 1 0.00 1 0 25 3.773e-01 8.459e-03 1.171e-01 1.800e-03 6.749700e-01 9.744064e-04 7.692099e-03 -6.000000e+00 2.217020e-01 223.18 -2.00 3.51 -2.00 320.91 0.00e+00 4.165575e-03 4.409280e-04 1.731643e-03 -6.000000e+00 9.952164e-03 279.89 -2.00 20.00 -2.00 320.38 0.00e+00 5.809 0.004 302.00 328.00 3 1.3219e-01 3.1347e-03 6.8394e-02 -6.0000e+00 5.4569e-01 7.7021e-02 4.2589e-03 3.9189e-02 -6.0000e+00 5.9425e-01 -6.0398e-02 4.3854e-03 1.8786e-02 -6.0000e+00 3.5321e-01 1.3361e-02 2.1236e-03 8.0872e-03 -6.0000e+00 1.5035e-01 7.4743e-04 -1.2730e-03 5.2459e-05 7.9581e-05 -6.0000e+00 1.1513e-02 1.6044e-02 -3.3708e-06 11 8 0 10 0 0 34.72 22.78 0.28 0.01604 0.00648 190 36 1 5 0 260.810 25.68 20.00 22.78 14.25 26.3 959.88 -92984 900000 -201263 12456 -118247 -142952 900000 -93614 -103922 -168517 -100388 -132995 -52901 57655 -33005 -71059 69468 49524 719 4174 -26024 -21396 -29474 -40254 -29861 31251 -27453 -15135 -46390 -636 -1096 -7949 -24745 -1439 38895 -13565 -9465 10345 6899 -9171 -1054 -8939 441 235 5437 -3359 1495 3794 5135 1135 -5 -2101 6224 6076 1390 3749 2387 3298 86 1195 4284 1884 9 1883 478 3687 194 3733 3457 189 896 953 -1090 410 -260 40 2541 897 -32 -92 905 -1442 -745 -1869 -1021 -1379 -1022 -911 -322 -311 1038 715 1342 1006 870 401 682 -438 -827 -447 -344 49 1191 -165 -1159 -1096 -930 -291 0 -322 -664 -134 -45 102 634 808 1196 58 -249 -889 -365 190 313 -198 364 144 1528 625 -21 435 375 381 228 372 -362 -95 115 -491 -843 -142 -68 111 301 -425 900000 -3025 23 -754 -1208 900000 -624 -845 -2748 -958 -2125 -509 247 -420 -1516 438 420 10 62 -526 -425 -675 -1112 -801 491 -757 -372 -1600 -16 -34 -310 -1261 -61 1129 -665 -506 553 454 -808 -96 -931 44 24 552 -379 168 435 621 155 -1 -364 1092 1149 289 798 523 714 19 260 954 474 3 584 156 1168 64 1251 1286 81 409 447 -512 180 -107 15 906 338 -14 -45 502 -908 -502 -1346 -768 -1094 -842 -764 -267 -251 790 519 957 745 712 370 702 -501 -1003 -543 -399 53 1201 -169 -1247 -1238 -1092 -360 -1 -463 -1027 -215 -72 162 968 1203 1781 90 -400 -1469 -601 305 488 -303 542 210 2170 918 -34 753 691 737 457 778 -792 -216 266 -1145 -1970 -324 -149 236 627 SS 20201120T131037.9Z 7629.549049 85 1 49.73 2 77.82 130.14 133.91 82.10 0.00 1 0.00 1 0 25 1.316e-01 6.750e-03 2.060e-02 8.876e-04 5.470782e-01 4.611633e-04 6.406008e-03 -6.000000e+00 7.676013e-02 223.18 -2.00 3.51 -2.00 319.91 0.00e+00 1.831893e-03 1.509801e-04 7.884563e-04 -6.000000e+00 3.424687e-03 279.88 -2.00 20.00 -2.00 319.30 0.00e+00 4.600 0.002 302.00 328.00 3 1.6540e-01 1.3354e-03 5.3675e-02 -6.0000e+00 1.8873e-01 4.0815e-02 1.6238e-03 2.8999e-02 -6.0000e+00 2.0536e-01 -2.2250e-02 1.4288e-03 1.4213e-02 -6.0000e+00 1.2258e-01 -7.5845e-04 7.3775e-04 4.7239e-03 -6.0000e+00 5.2155e-02 2.5902e-03 -9.3874e-04 2.6354e-05 5.4000e-05 -6.0000e+00 3.9487e-03 1.5597e-02 -1.0868e-06 11 8 0 10 0 0 56.45 22.78 0.18 0.01560 0.00854 339 64 1 5 0 144.940 25.68 20.00 22.78 15.53 26.6 965.45 -54606 3475 -69188 -34360 -45544 -50158 4378 -45070 -22913 -60614 -17398 -42259 -12209 -10484 -9958 -14126 -17784 3706 -5792 3047 -7437 897 -12670 -4119 -9317 1911 -8354 -6413 -8110 -1437 3946 -1860 -3989 -3113 7342 -5601 1224 275 1096 -3015 -2487 -2730 -1737 -17 -479 -88 404 1674 778 1528 938 1246 1889 1888 1193 1094 620 457 1585 880 2531 1756 951 348 230 1413 289 2442 1341 434 -325 -259 -1025 -252 -213 260 1092 1257 149 -237 -253 -1774 -1185 -1545 -810 -971 -756 -559 -335 -59 405 701 1357 1578 1024 987 729 -345 -716 -388 -432 271 959 -46 -1139 -703 -793 -310 108 -329 -443 -335 -2 95 598 1021 934 456 -445 -791 -575 -144 -211 69 131 345 1517 963 453 308 128 320 239 257 -375 -209 84 -357 -606 -81 -218 37 211 -737 31 -1203 -438 -572 -684 42 -748 -336 -1382 -281 -1033 -276 -290 -329 -557 -744 147 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